447652 -OEChem-10051719573D 33 35 0 0 0 0 0 0 0999 V2000 2.6054 2.0564 -1.1677 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8917 0.1412 0.2646 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7427 -0.4708 -1.7113 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3256 -0.1394 -0.0492 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7965 -1.5131 1.2761 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5852 0.4103 0.2031 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9489 -0.6542 -0.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9683 0.2233 -0.6146 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4948 -1.0158 -1.5434 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3287 -0.9947 0.2481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8572 0.7780 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0843 1.0082 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9147 -1.8664 -2.5962 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9118 1.5161 1.8846 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0574 1.6271 0.9958 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -2.1129 1.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5181 -0.4550 0.4909 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7492 -2.3248 1.5302 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5633 1.5672 -0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9218 2.2194 -0.6375 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9778 0.6614 2.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9441 1.0982 -0.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -1.9379 -3.4594 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0389 -1.4566 -2.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7399 -2.8797 -2.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9342 2.0317 2.8369 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8967 2.2284 1.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3363 -2.7893 1.2648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9675 -3.1791 2.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4696 0.1408 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2331 2.5182 0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8791 3.1070 -1.2749 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6521 1.5197 -1.0539 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 8 2 0 0 0 0 3 9 1 0 0 0 0 4 10 2 0 0 0 0 4 17 1 0 0 0 0 5 17 2 0 0 0 0 5 18 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 6 30 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 16 1 0 0 0 0 11 14 2 0 0 0 0 11 21 1 0 0 0 0 12 15 2 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 M END > DB02538 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/ZCRPPLDDHBLUES-UHFFFAOYSA-N/SDF?record_type=3d > CC(=O)NC1=NC(=CC=N1)C1=C(C)N=C2C=CC=CN12 > InChI=1S/C14H13N5O/c1-9-13(19-8-4-3-5-12(19)16-9)11-6-7-15-14(18-11)17-10(2)20/h3-8H,1-2H3,(H,15,17,18,20) > ZCRPPLDDHBLUES-UHFFFAOYSA-N > C14H13N5O > 267.2859 > 267.112010063 > 4 > 33 > 0.012522088146012017 > 28.297761655954766 > 1 > 1 > 0 > 1 > N-(4-{2-methylimidazo[1,2-a]pyridin-3-yl}pyrimidin-2-yl)acetamide > 2.01 > 0.8369824340000005 > -3.86 > 0 > 0 > 3 > 0 > 11.020895763963582 > 5.106585104572933 > 72.18 > 76.6429 > 2 > 1 > 3.71e-02 g/l > tetrahydrofolic acid > 0 $$$$